(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetic acid
Chemical Structure Depiction of
(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetic acid
(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetic acid
Compound characteristics
| Compound ID: | 3039-0505 |
| Compound Name: | (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetic acid |
| Molecular Weight: | 238.2 |
| Molecular Formula: | C9 H10 N4 O4 |
| Smiles: | CN1C(c2c(ncn2CC(O)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.7204 |
| logD: | -5.3013 |
| logSw: | -0.5297 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.616 |
| InChI Key: | HCYFGRCYSCXKNQ-UHFFFAOYSA-N |